2-(6-aminopurin-9-yl)-5-[3-(1H-indol-3-yl)propylsulfanylmethyl]oxolane-3,4-diol

Systemtic Name: 2-(6-aminopurin-9-yl)-5-[3-(1H-indol-3-yl)propylsulfanylmethyl]oxolane-3,4-diol Openeye Name: 2-(6-aminopurin-9-yl)-5-[3-(1H-indol-3-yl)propylsulfanylmethyl]tetrahydrofuran-3,4-diol CAS Name: 2-(6-aminopurin-9-yl)-5-[[3-(1H-indol-3-yl)propylthio]methyl]oxolane-3,4-diol IUPAC Name: 2-(6-aminopurin-9-yl)-5-[3-(1H-indol-3-yl)propylsulfanylmethyl]oxolane-3,4-diol Traditional Name: 2-adenin-9-yl-5-[[3-(1H-indol-3-yl)propylthio]methyl]tetrahydrofuran-3,4-diol Formula: C21H24N6O3S MolecularWeight: 440.51866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCCSCC3C(C(C(O3)N4C=NC5=C4N=CN=C5N)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCCSCC3C(C(C(O3)N4C=NC5=C4N=CN=C5N)O)O

InChI

InChI=1S/C21H24N6O3S/c22-19-16-20(25-10-24-19)27(11-26-16)21-18(29)17(28)15(30-21)9-31-7-3-4-12-8-23-14-6-2-1-5-13(12)14/h1-2,5-6,8,10-11,15,17-18,21,23,28-29H,3-4,7,9H2,(H2,22,24,25)